Vitas-M small molecule compound

N-cyclohexyl-N~2~-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]carbonyl}-L-valinamide

Catalog ID
STK605898
SMILES CC([C@@H](C(=O)NC1CCCCC1)NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H33N3O5 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33N3O5/c1-15(2)22(24(30)25-17-6-4-3-5-7-17)26-23(29)16-12-21(28)27(14-16)18-8-9-19-20(13-18)32-11-10-31-19/h8-9,13,15-17,22H,3-7,10-12,14H2,1-2H3,(H,25,30)(H,26,29)/t16?,22-/m0/s1
InChIKey
UXPWCCPPBDTTOQ-XLDIYJRPSA-N
Synonyms
1013982-25-6
1013982256
CC((C@@H)(C(=O)NC1CCCCC1)NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)C
CC(C)C(C(=O)NC1CCCCC1)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4
InChI=1SC24H33N3O5c115(2)22(24(30)25176435717)2623(29)161221(28)27(1416)18891920(1318)3211103119h8913151722H37101214H212H3(H2530)(H2629)t16?22m0s1
MFCD18246202
N((2S)1(cyclohexylamino)3methyl1oxobutan2yl)1(23dihydro14benzodioxin6yl)5oxopyrrolidine3carboxamide
N((S)1(cyclohexylamino)3methyl1oxobutan2yl)1(23dihydrobenzo(b)(14)dioxin6yl)5oxopyrrolidine3carboxamide
NcyclohexylN~2~((1(23dihydro14benzodioxin6yl)5oxopyrrolidin3yl)carbonyl)Lvalinamide
NCYCLOHEXYLN2((1(23DIHYDRO14BENZODIOXIN6YL)5OXOPYRROLIDIN3YL)CARBONYL)LVALINAMIDE
ZINC000009046003
ZINC000009046005

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.